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Theophylline-1,3-15N2-2-13C

Theophylline-1,3-15N2-2-13C

  • CAT Number: R063868
  • CAS Number: 84718-95-6
  • Molecular Formula: C7H8N4O2
  • Molecular Weight: 183.146
  • Purity: ≥95%
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Theophylline-1,3-15N2-2-13C (CAT: R063868) is an isotopically labeled form of theophylline, a bronchodilator used in respiratory conditions like asthma and COPD. This labeled compound plays a pivotal role in scientific research, serving as a tracer in pharmacological and metabolic studies. By incorporating stable isotopes (13C and 15N) into its structure, researchers can investigate its metabolic pathways, pharmacokinetics, and drug metabolism within biological systems.

Catalog Number R063868
CAS Number 84718-95-6
Synonyms

3,7-Dihydro-1,3-dimethyl-1H-purine-2,6-dione-2-13C-1,3-15N2 ; 3,9-Dihydro-1,3-dimethyl-1H-purine-2,6-dione-1,3-15N2-2-13C; 3,7-Dihydro-1,3-dimethyl-1H-purine-2,6-dione-1,3-15N2-2-13C; 1,3-Dimethylxanthine-1,3-15N2-2-13C; Accurbron-1,3-15N2-2-13C; Aer

Molecular Formula

C7H8N4O2

Purity 95%
Storage -20°C
IUPAC Name 1,3-dimethyl-7H-purine-2,6-dione
InChI InChI=1S/C7H8N4O2/c1-10-5-4(8-3-9-5)6(12)11(2)7(10)13/h3H,1-2H3,(H,8,9)/i7+1,10+1,11+1
InChIKey ZFXYFBGIUFBOJW-NBLDSOAPSA-N
SMILES CN1C2=C(C(=O)N(C1=O)C)NC=N2

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